1-[(2S)-2-azanyl-2-(4-propylphenyl)ethyl]azepan-2-one

Systemtic Name: 1-[(2S)-2-azanyl-2-(4-propylphenyl)ethyl]azepan-2-one Openeye Name: 1-[(2S)-2-amino-2-(4-propylphenyl)ethyl]azepan-2-one CAS Name: 1-[(2S)-2-amino-2-(4-propylphenyl)ethyl]-2-azepanone IUPAC Name: 1-[(2S)-2-amino-2-(4-propylphenyl)ethyl]azepan-2-one Traditional Name: 1-[(2S)-2-amino-2-(4-propylphenyl)ethyl]azepan-2-one Formula: C17H26N2O MolecularWeight: 274.40114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(CN2CCCCCC2=O)N

Isomeric SMILES

CCCC1=CC=C(C=C1)[C@@H](CN2CCCCCC2=O)N

InChI

InChI=1S/C17H26N2O/c1-2-6-14-8-10-15(11-9-14)16(18)13-19-12-5-3-4-7-17(19)20/h8-11,16H,2-7,12-13,18H2,1H3/t16-/m1/s1